SCHEMBL11057978

SCHEMBL11057978

[O]C(=O)C(c1ccccc1)S(=O)(=O)O

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.73
PTPN1 P18031 3/20 0.49
PTPN6 P29350 3/20 0.49
PTPN11 Q06124 3/20 0.49
ALDH1A1 P00352 1/20 0.48
ACP1 P24666 7/20 0.46
PTPN12 Q05209 3/20 0.46
PTPN7 P35236 2/20 0.46
PTPN13 Q12923 2/20 0.46
SSU72 Q9NP77 2/20 0.46
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.42
LMNA P02545 3/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MAPK1 P28482 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9912818 0.84 SRC (1.00) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL11166146 0.84 SRC (1.00) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL20869602 0.84 SRC (1.00) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL5016643 0.83 SRC (0.96) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL28406293 0.83 SRC (0.96) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL28403215 0.83 SRC (0.96) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL8121173 0.81 SRC (0.70) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL10671823 0.81 SRC (0.70) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL9912817 0.81 SRC (0.70) SRCPTPN1PTPN6PTPN11ALDH1A1
SCHEMBL13619014 0.81 SRC (0.70) SRCPTPN1PTPN6PTPN11ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4463172-A Process for producing 2-methyl cephem-2-em and 2-methylcephem-3-em derivitaves TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-07-31 US disclosed
EP-0006011-B1 CEPHALOSPORINS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Takeda Chemical Industries, Ltd. (JP) 1983-04-06 EP disclosed
EP-0033241-A2 Pharmaceutical compositions for rectal administration Takeda Chemical Industries, Ltd. (JP) 1981-08-05 EP disclosed
US-4239758-A BACTERICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1980-12-16 US disclosed
US-4238608-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1980-12-09 US disclosed
US-4236001-A 7β-Acyloxy-3-heterocyclicthiomethyl cephalosporins SMITHKLINE CORPORATION (US) 1980-11-25 US disclosed
US-4218564-A 7β-Hydroxy-3-heterocyclicthio-methyl cephalosporin intermediates SMITHKLINE CORPORATION (US) 1980-08-19 US disclosed
US-4172891-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 1979-10-30 US disclosed
US-4158733-A 7β-Acyloxy-3-acetoxymethyl cephalosporins SMITHKLINE CORPORATION (US) 1979-06-19 US disclosed
US-4131734-A 7β-Acyloxy-3-heterocyclicthiomethyl cephalosporins SMITHKLINE CORPORATION (US) 1978-12-26 US disclosed
US-4020057-A 7β-Acyloxy cephalosporins SMITHKLINE CORPORATION (US) 1977-04-26 US disclosed